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Methyl (3S)-4-{(1S,5R,7R)-10,10-dimethyl-3,3-dioxo-3.lambda.6-thia-4-aza-tricyclo[5.2.1.0(1,5)]dec-4-yl}-3-methyl-4-oxo-butanoate

View entire compound with spectra: 1 MS (GC)

Methyl (3S)-4-{(1S,5R,7R)-10,10-dimethyl-3,3-dioxo-3.lambda.6-thia-4-aza-tricyclo[5.2.1.0(1,5)]dec-4-yl}-3-methyl-4-oxo-butanoate
SpectraBase Compound ID AyghGioI4R9
InChI InChI=1S/C16H25NO5S/c1-10(7-13(18)22-4)14(19)17-12-8-11-5-6-16(12,15(11,2)3)9-23(17,20)21/h10-12H,5-9H2,1-4H3/t10-,11-,12+,16+/m0/s1
InChIKey WDRSZCFRKVLTMR-XSUJLISDSA-N
Mol Weight 343.44 g/mol
Molecular Formula C16H25NO5S
Exact Mass 343.145344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 67OzG3huIAg
Name Methyl (3S)-4-{(1S,5R,7R)-10,10-dimethyl-3,3-dioxo-3.lambda.6-thia-4-aza-tricyclo[5.2.1.0(1,5)]dec-4-yl}-3-methyl-4-oxo-butanoate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H25NO5S
InChI InChI=1S/C16H25NO5S/c1-10(7-13(18)22-4)14(19)17-12-8-11-5-6-16(12,15(11,2)3)9-23(17,20)21/h10-12H,5-9H2,1-4H3/t10-,11-,12+,16+/m0/s1
InChIKey WDRSZCFRKVLTMR-XSUJLISDSA-N
Molecular Weight 343.438 g/mol
SMILES [C@@]12(N(S(C[C@@]11C([C@@](C2)([H])CC1)(C)C)(=O)=O)C([C@](CC(=O)OC)(C)[H])=O)[H]
SPLASH splash10-004i-5911000000-18089c4199f415a3057d
Source of Spectrum F-69-3491-8
Synonyms Methyl (3S)-4-{(1S,5R,7R)-10,10-dimethyl-3,3-dioxo-3.lamta.6-thia-4-azatricyclo[5.2.1.0(1,5)]dec-4-yl}-3-methyl-4-oxobutanoate (S)-methyl 4-((3aS,6R,7aR)-8,8-dimethyl-2,2-dioxidohexahydro-1H-3a,6-methanobenzo[c]isothiazol-1-yl)-3-methyl-4-oxobutanoate
Wiley ID 1737977